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Home Carboxys Ethyl 2-amino-4-(pyridin-4-yl)thiophene-3-carboxylate

Ethyl 2-amino-4-(pyridin-4-yl)thiophene-3-carboxylate

CAS No.:
117516-88-8
Catalog Number:
AG007QXO
Molecular Formula:
C12H12N2O2S
Molecular Weight:
248.3009
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$49
- +
5g
98%
In Stock USA
United States
$144
- +
25g
98%
In Stock USA
United States
$519
- +
Product Description
Catalog Number:
AG007QXO
Chemical Name:
Ethyl 2-amino-4-(pyridin-4-yl)thiophene-3-carboxylate
CAS Number:
117516-88-8
Molecular Formula:
C12H12N2O2S
Molecular Weight:
248.3009
MDL Number:
MFCD01922021
IUPAC Name:
ethyl 2-amino-4-pyridin-4-ylthiophene-3-carboxylate
InChI:
InChI=1S/C12H12N2O2S/c1-2-16-12(15)10-9(7-17-11(10)13)8-3-5-14-6-4-8/h3-7H,2,13H2,1H3
InChI Key:
LKLAPQXKZAVVPT-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1c(N)scc1c1ccncc1
Properties
Complexity:
269  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.062g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
248.3g/mol
Monoisotopic Mass:
248.062g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
93.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties